2-methyl-3-oxidanylidene-4-(1-phenylethyl)-N-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: 2-methyl-3-oxidanylidene-4-(1-phenylethyl)-N-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: 2-methyl-3-oxo-4-(1-phenylethyl)-N-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: 2-methyl-3-oxo-4-(1-phenylethyl)-N-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 2-methyl-3-oxo-4-(1-phenylethyl)-N-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: 3-keto-2-methyl-4-(1-phenylethyl)-N-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C20H30N4OS MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCC2(CC1)NC(C(=O)N2C(C)C3=CC=CC=C3)C

Isomeric SMILES

CCCNC(=S)N1CCC2(CC1)NC(C(=O)N2C(C)C3=CC=CC=C3)C

InChI

InChI=1S/C20H30N4OS/c1-4-12-21-19(26)23-13-10-20(11-14-23)22-15(2)18(25)24(20)16(3)17-8-6-5-7-9-17/h5-9,15-16,22H,4,10-14H2,1-3H3,(H,21,26)